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114626-96-9

114626-96-9 | 6-Oxatetracyclo[7.3.0.02,5.05,7]dodecan-8-one, 2,7,11,11-tetramethyl-

CAS No: 114626-96-9 Catalog No: AG000EV5 MDL No:

Product Description

Catalog Number:
AG000EV5
Chemical Name:
6-Oxatetracyclo[7.3.0.02,5.05,7]dodecan-8-one, 2,7,11,11-tetramethyl-
CAS Number:
114626-96-9
Molecular Formula:
C15H22O2
Molecular Weight:
234.3340
IUPAC Name:
2,7,11,11-tetramethyl-6-oxatetracyclo[7.3.0.02,5.05,7]dodecan-8-one
InChI:
InChI=1S/C15H22O2/c1-12(2)7-9-10(8-12)13(3)5-6-15(13)14(4,17-15)11(9)16/h9-10H,5-8H2,1-4H3
InChI Key:
RYYPGZDUHDUHEO-UHFFFAOYSA-N
SMILES:
O=C1C2CC(CC2C2(C3(C1(C)O3)CC2)C)(C)C

Properties

Complexity:
440  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.162g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
234.339g/mol
Monoisotopic Mass:
234.162g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.6A^2
Undefined Atom Stereocenter Count:
5  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  

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